IFLAB-ZINC04554439 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.1260 1.0160 -2.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -0.3700 -2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -0.9260 -2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -2.3120 -1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 -2.8450 -1.6310 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9750 -4.0610 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -4.7160 -0.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3670 -4.6040 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2600 -3.9500 -1.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6300 -5.8210 -0.6350 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9940 -6.3540 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0020 -7.7760 -0.1080 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7110 -7.7510 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3870 -8.3570 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9680 -8.4970 -1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2380 -9.0310 -1.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9320 -9.4260 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3470 -9.2850 0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0720 -8.7550 0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2220 -9.7420 1.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1810 -10.5390 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1740 -9.9710 -0.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9150 -8.1270 -2.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8750 -8.9820 -2.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 -10.3560 -2.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4120 -10.8560 -1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4570 -10.0200 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 1.4120 -2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 0.9400 -3.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.6840 -2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -1.0380 -2.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -0.2940 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 -0.2580 -1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 -1.0030 -3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -2.9800 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 -2.2360 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4260 -2.3220 -2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9160 -6.3440 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6480 -5.7200 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3500 -6.3700 -1.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4280 -8.1890 -2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6890 -9.1390 -2.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6140 -8.6480 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8660 -11.5820 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1700 -10.4490 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 -7.0870 -2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8740 -8.2070 -2.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8100 -8.6680 -4.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9030 -8.8610 -2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7350 -11.8960 -1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 -10.7890 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4250 -10.1300 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5290 -10.3620 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0530 -8.6070 -0.8610 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 54 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 M END